ChemSpider 2D Image | 1-(Bicyclo[2.2.1]hept-2-ylmethoxy)-3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-propanol | C22H33ClN2O2

1-(Bicyclo[2.2.1]hept-2-ylmethoxy)-3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-propanol

  • Molecular FormulaC22H33ClN2O2
  • Average mass392.963 Da
  • Monoisotopic mass392.223053 Da
  • ChemSpider ID21740294

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-(Bicyclo[2.2.1]hept-2-ylmethoxy)-3-[4-(5-chlor-2-methylphenyl)-1-piperazinyl]-2-propanol [German] [ACD/IUPAC Name]
1-(Bicyclo[2.2.1]hept-2-ylmethoxy)-3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-propanol [ACD/IUPAC Name]
1-(Bicyclo[2.2.1]hept-2-ylméthoxy)-3-[4-(5-chloro-2-méthylphényl)-1-pipérazinyl]-2-propanol [French] [ACD/IUPAC Name]
1-(Bicyclo[2.2.1]hept-2-ylmethoxy)-3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propan-2-ol
1-Piperazineethanol, α-[(bicyclo[2.2.1]hept-2-ylmethoxy)methyl]-4-(5-chloro-2-methylphenyl)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 539.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.0±3.0 kJ/mol
Flash Point: 280.1±30.1 °C
Index of Refraction: 1.566
Molar Refractivity: 109.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 241.21
ACD/KOC (pH 5.5): 850.11
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2735.89
ACD/KOC (pH 7.4): 9642.34
Polar Surface Area: 36 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 45.1±3.0 dyne/cm
Molar Volume: 337.1±3.0 cm3

Click to predict properties on the Chemicalize site


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